PUBCHEM-ZINC06547584 MOE2007 3D CORINA 3.40 0006 02.08.2006 60 61 0 0 1 0 0 0 0 0999 V2000 0.0220 1.5110 -0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 -0.0190 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3310 -0.5140 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4970 -1.8460 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 -2.5740 -0.0190 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8850 -2.4330 0.0160 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.4070 -2.1050 0.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6530 -1.9620 -1.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0780 -2.4470 -1.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0400 -1.6660 -0.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3470 -2.1090 -0.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6920 -3.3390 -0.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7240 -4.1210 -1.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4200 -3.6710 -1.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0890 -5.4340 -2.1890 N 0 3 0 0 0 0 0 0 0 0 0 0 -6.2390 -6.1200 -2.7270 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.2400 -5.8280 -2.1260 O 0 5 0 0 0 0 0 0 0 0 0 0 -8.9770 -3.7770 -0.9270 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.9200 -2.9200 -0.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7960 -3.8950 0.0080 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6380 -4.5670 1.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5680 -3.9610 2.2130 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5470 -6.0720 1.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3700 -6.5800 2.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2800 -8.0840 2.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3490 -8.6900 1.5320 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1210 -8.7560 3.7380 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1340 -10.1550 3.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5950 -10.8590 2.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6090 -12.2400 2.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1590 -12.9220 3.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6960 -12.2240 4.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6800 -10.8430 4.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1730 -14.4290 3.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0460 1.8820 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5080 1.8740 -0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4820 1.8660 0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5370 -0.3740 -0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5630 -0.3820 0.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6420 -0.8720 -1.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1810 -2.3640 -2.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7710 -0.7090 -0.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0980 -1.4980 0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6670 -4.2770 -2.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6100 -2.7510 0.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9640 -1.9670 -0.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9040 -3.3880 -0.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8520 -4.3800 -0.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4610 -6.4880 0.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6930 -6.3810 0.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4560 -6.1630 3.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2240 -6.2700 3.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9980 -8.2700 4.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1660 -10.3270 1.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1910 -12.7880 1.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1250 -12.7590 5.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0950 -10.2980 5.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2600 -14.7990 4.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0370 -14.7830 4.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2300 -14.7950 2.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 38 1 0 0 0 0 2 39 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 20 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 42 1 0 0 0 0 11 12 1 0 0 0 0 11 43 1 0 0 0 0 12 13 2 0 0 0 0 12 18 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 14 44 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 18 19 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 20 48 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 49 1 0 0 0 0 23 50 1 0 0 0 0 24 25 1 0 0 0 0 24 51 1 0 0 0 0 24 52 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 53 1 0 0 0 0 28 29 1 0 0 0 0 28 33 2 0 0 0 0 29 30 2 0 0 0 0 29 54 1 0 0 0 0 30 31 1 0 0 0 0 30 55 1 0 0 0 0 31 32 2 0 0 0 0 31 34 1 0 0 0 0 32 33 1 0 0 0 0 32 56 1 0 0 0 0 33 57 1 0 0 0 0 34 58 1 0 0 0 0 34 59 1 0 0 0 0 34 60 1 0 0 0 0 M CHG 1 15 1 M CHG 1 17 -1 M END